SCHEMBL6826083

SCHEMBL6826083

CC(=O)NC[C@H]1CN(c2ccc(N(C)Cc3ccncc3)c(F)c2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
MAOB P27338 4/20 0.57
CALML3 P27482 2/20 0.57
PTGS1 P23219 2/20 0.57
SDHA P31040 2/20 0.57
LMNA P02545 1/20 0.57
F10 P00742 2/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6826084 1.00 MAOA (0.57) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6823173 0.92 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6823171 0.92 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6924220 0.90 CALML3 (0.48) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6924223 0.90 CALML3 (0.48) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6826244 0.86 MAOA (0.54) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6826149 0.86 MAOA (0.59) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6826150 0.86 MAOA (0.59) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL1393626 0.85 CALML3 (0.60) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6823023 0.85 MAOA (0.56) MAOAMAOBCALML3PTGS1SDHA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004101552-A1 OXAZOLIDINONE DERIVATIVES AS ANTIBACTERIAL AGENTS ORCHID CHEMICALS & PHARMACEUTICALS LTD (IN) 2004-11-25 WO claimed